| SpectraBase Compound ID | DOfYmCfsanf |
|---|---|
| InChI | InChI=1S/C8H6O2S/c9-11(10)6-5-7-3-1-2-4-8(7)11/h1-6H/i6D |
| InChIKey | FRJNKYGTHPUSJR-RAMDWTOOSA-N |
| Mol Weight | 167.2 g/mol |
| Molecular Formula | C8H5DO2S |
| Exact Mass | 167.015127 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I3XPe5LVY2E |
|---|---|
| Name | .alpha.-Deuterobenzothiophensulphone |
| CAS Registry Number | 19418-89-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5DO2S |
| InChI | InChI=1S/C8H6O2S/c9-11(10)6-5-7-3-1-2-4-8(7)11/h1-6H/i6D |
| InChIKey | FRJNKYGTHPUSJR-RAMDWTOOSA-N |
| Molecular Weight | 167.200 g/mol |
| SMILES | C=1(S(c2c(C1)cccc2)(=O)=O)[D] |
| SPLASH | splash10-00kr-4900000000-a1b9b2842ee6c79e9ff0 |
| Source of Spectrum | AD-0-1326-0 |
| Wiley ID | 14232 |